CID 94220

Lactamide

Structural Information

Molecular Formula
C3H7NO2
SMILES
CC(C(=O)N)O
InChI
InChI=1S/C3H7NO2/c1-2(5)3(4)6/h2,5H,1H3,(H2,4,6)
InChIKey
SXQFCVDSOLSHOQ-UHFFFAOYSA-N
Compound name
2-hydroxypropanamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

21
References

11221
Patents

89.047676 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 90.054952 115.8
[M+Na]+ 112.036894 122.8
[M-H]- 88.040400 114.7
[M+NH4]+ 107.081499 138.1
[M+K]+ 128.010834 123.2
[M+H-H2O]+ 72.044936 111.6
[M+HCOO]- 134.045877 138.1
[M+CH3COO]- 148.061527 164.3
[M+Na-2H]- 110.022342 120.4
[M]+ 89.04712742 113.0
[M]- 89.04822458 113.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe